AG0039TV

81090-53-1 | 4,4'-Dibromotriphenylamine

AG0039TV

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CAS Number	81090-53-1
Catalog Number	AG0039TV(AGN-PC-00N7WF)
Chemical Name	4,4'-Dibromotriphenylamine
IUPAC Name	4-bromo-N-(4-bromophenyl)-N-phenylaniline
InChI	InChI=1S/C18H13Br2N/c19-14-6-10-17(11-7-14)21(16-4-2-1-3-5-16)18-12-8-15(20)9-13-18/h1-13H
InChI Key	KIGVOJUDEQXKII-UHFFFAOYSA-N
MDL Number	MFCD00060104
Molecular Formula	C18H13Br2N
Molecular Weight	403.1105
SMILES	BrC1=CC=C(C=C1)N(C1=CC=CC=C1)C1=CC=C(C=C1)Br
Synonyms	81090-53-1, 4,4'-Dibromotriphenylamine, 4-Bromo-N-(4-bromophenyl)-N-phenylaniline, N,N-Bis(4-bromophenyl)aniline, 4,4-Dibromotriphenylamine, 4-bromo-N-(4-bromophenyl)-N-phenylBenzenamine, MFCD00060104, AK115131, Dibromotriphenylamine, 4,4'-dibromotriphenylamine;, 4,4'-Dibromo-triphenylamine, 4,4\'-Dibromotriphenylamine, C18H13Br2N, Bis(4-bromophenyl)phenylamine, SCHEMBL680815, 4,4 inverted exclamation mark -Dibromotriphenylamine, bis(4-bromophenyl)phenylamine;, N,N-Bis(p-bromophenyl)aniline, EOS583, N,N-di(4-bromophenyl)aniline;, KS-00000NTZ, N,N-bis(4-bromophenyl)aniline;, DTXSID50544606, bis(4-bromo-phenyl)-phenyl-amine, KIGVOJUDEQXKII-UHFFFAOYSA-N, 4,4'-Dibromotriphenylamine, 96%, ZINC2528023, EBD861465, N,N-bis(4-bromophenyl)aminobenzene;, AKOS015901922, AJ-38206, AS-19017, OR315393, SY033977, AX8092114, DB-075733, D1910, FT-0703939, ST24043480, X4105, MFCD00060104 (98%), M-1061, 4-bromo-N-(4-bromophenyl)-N-phenylbenzenamine;, 090D531, C-44729, 4,4 inverted exclamation marka-Dibromotriphenylamine, I14-14358, 3-Bromo-N,N-diphenylaniline, ACN-048557, 4,4'-Dibromotriphenylamine, 98% - 1G 1g, Benzenamine, 4-bromo-N-(4-bromophenyl)-N-phenyl-,

Complexity	278
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	402.939g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	403.117g/mol
Monoisotopic Mass	400.941g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	3.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	7.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H317-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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